| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | SAM61DOI2G |
| EPA CompTox | DTXSID00867711 |
Structure
| InChI Key | WPGWHDYIRYZAHO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10N2O1 |
| Molecular Weight | 138.08 |
| AlogP | 1.05 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 35.01 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 68039-50-9 |
| NORMAN SUSDAT | |
| FDA SRS | SAM61DOI2G |
CONTENTS
